Match comparison for X Force Atom 1 [step 20] (match type 14057)

Commits > Commit dfb998a08bfe04488932b5e2d20d2b9995cc9a79 > Input 19-td_move_ions.02-td.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.587430783005920e+01 7.940000000000000e-13 -1.587430783005919e+01 2.614240931749016e-14 -1.587430783005915e+01 7.460698725481052e-14 PASS

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Detailed information

Reference: -15.8743078300592, precision: 0.000000000000794
Run Value Difference Relative difference Status
foss-2022a_ppc -1.587430783005908e+01 1.225686219186173e-13 1.543685414592157e-01 PASS
cmake_foss_2022a_full_serial -1.587430783005919e+01 1.421085471520200e-14 1.789780190831487e-02 PASS
foss-2022a_opt -1.587430783005921e+01 -8.881784197001252e-15 -1.118612619269679e-02 PASS
intel-2022a -1.587430783005917e+01 3.019806626980426e-14 3.803282905516909e-02 PASS
cmake_foss_2022a_full_mpi -1.587430783005919e+01 1.421085471520200e-14 1.789780190831487e-02 PASS
cmake_foss_2022a_min_serial -1.587430783005919e+01 1.421085471520200e-14 1.789780190831487e-02 PASS
foss-2022a_omp -1.587430783005921e+01 -1.421085471520200e-14 -1.789780190831487e-02 PASS
cmake_foss_2022a_min_mpi -1.587430783005922e+01 -2.131628207280301e-14 -2.684670286247230e-02 PASS
eb_fosscuda-2022a -1.587430783005919e+01 7.105427357601002e-15 8.948900954157433e-03 PASS
intel-2022a_impi -1.587430783005921e+01 -1.421085471520200e-14 -1.789780190831487e-02 PASS
eb_foss-2022a -1.587430783005921e+01 -8.881784197001252e-15 -1.118612619269679e-02 PASS
spack_foss-2022a_cuda_mpi_omp -1.587430783005920e+01 1.776356839400250e-15 2.237225238539358e-03 PASS
eb_foss-2022a_debug -1.587430783005921e+01 -8.881784197001252e-15 -1.118612619269679e-02 PASS
eb_foss-2022b_libxc6 -1.587430783005921e+01 -8.881784197001252e-15 -1.118612619269679e-02 PASS
eb_foss-2022a_mpi -1.587430783005921e+01 -8.881784197001252e-15 -1.118612619269679e-02 PASS
foss-2022a_mpi_omp -1.587430783005923e+01 -2.664535259100376e-14 -3.355837857809037e-02 PASS
eb_foss-2022b_libxc6_mpi -1.587430783005921e+01 -8.881784197001252e-15 -1.118612619269679e-02 PASS
intel-2022b -1.587430783005917e+01 3.019806626980426e-14 3.803282905516909e-02 PASS
eb_foss-2022a_mpi_debug -1.587430783005921e+01 -8.881784197001252e-15 -1.118612619269679e-02 PASS
spack_foss-2022a_serial -1.587430783005920e+01 1.776356839400250e-15 2.237225238539358e-03 PASS
intel-2022a_omp -1.587430783005919e+01 7.105427357601002e-15 8.948900954157433e-03 PASS
spack_foss-2022a_mpi -1.587430783005920e+01 -3.552713678800501e-15 -4.474450477078716e-03 PASS
spack_foss-2022a_serial_debug -1.587430783005920e+01 1.776356839400250e-15 2.237225238539358e-03 PASS
spack_foss-2022a_serial_min -1.587430783005920e+01 1.776356839400250e-15 2.237225238539358e-03 PASS
intel-2022b_impi -1.587430783005921e+01 -1.421085471520200e-14 -1.789780190831487e-02 PASS
spack_foss-2022a_serial_omp -1.587430783005919e+01 7.105427357601002e-15 8.948900954157433e-03 PASS
spack_foss-2022a_serial_opt -1.587430783005919e+01 1.421085471520200e-14 1.789780190831487e-02 PASS
spack_foss-2022a_mpi_omp -1.587430783005919e+01 1.421085471520200e-14 1.789780190831487e-02 PASS
intel-2022a_omp_impi -1.587430783005920e+01 1.776356839400250e-15 2.237225238539358e-03 PASS